2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide

C20H20FN7O — CID 123667405

IUPAC2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide
SMILESCN(C)C(=O)Cn1ccc(Nc2cc3[nH]ncc3c(Cc3ccccc3F)n2)n1
InChIInChI=1S/C20H20FN7O/c1-27(2)20(29)12-28-8-7-18(26-28)24-19-10-17-14(11-22-25-17)16(23-19)9-13-5-3-4-6-15(13)21/h3-8,10-11H,9,12H2,1-2H3,(H,22,25)(H,23,24,26)
InChIKeyWJUUXCGEGMYCBZ-UHFFFAOYSA-N
MW393.43 g/mol
LogP2.72
Rot. Bonds6

About 2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide

2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide (PubChem CID 123667405) has the molecular formula C20H20FN7O and a molecular weight of 393.43 g/mol. Its IUPAC name is 2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide
PubChem CID123667405
Molecular FormulaC20H20FN7O
Molecular Weight393.43 g/mol
Exact Mass393.17
IUPAC Name2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide
SMILESCN(C)C(=O)Cn1ccc(Nc2cc3[nH]ncc3c(Cc3ccccc3F)n2)n1
InChIInChI=1S/C20H20FN7O/c1-27(2)20(29)12-28-8-7-18(26-28)24-19-10-17-14(11-22-25-17)16(23-19)9-13-5-3-4-6-15(13)21/h3-8,10-11H,9,12H2,1-2H3,(H,22,25)(H,23,24,26)
InChIKeyWJUUXCGEGMYCBZ-UHFFFAOYSA-N
XLogP2.72
TPSA91.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.43
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(2-fluorophenyl)methyl]-N-(1-methyl-1,2,4-triazol-3-yl)-1H-pyrazolo[4,3-c]pyridin-6-amine
CID 123466176
N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine
CID 123894948
N-[1-[2-(dimethylamino)-2-oxoethyl]pyrazol-3-yl]naphthalene-1-carboxamide
CID 167781776
2-[3-[[4-(benzylamino)-5-methanimidoyl-2-pyridinyl]amino]pyrazol-1-yl]-N,N-dimethylacetamide
CID 144519958
2-(3-aminopyrazol-1-yl)-N-[(2-fluorophenyl)methyl]acetamide
CID 55035632
1-ethyl-3-[2-(2-fluorophenyl)ethyl]-1-methylurea
CID 115603918
N,N-dimethyl-2-[4-(1H-pyrazolo[5,4-d]pyrimidin-4-ylamino)pyrazol-1-yl]acetamide
CID 133276027
2-(2-fluorophenyl)-N-(1-methylpyrazol-3-yl)acetamide
CID 16622031
5-ethyl-N-[2-(2-fluorophenyl)ethyl]-1H-pyrazole-4-carboxamide
CID 72930885
4-[5-[(4-chloro-1H-indazol-5-yl)methyl]-1-methyl-1,2,4-triazol-3-yl]-N-ethyl-3,5-difluorobenzamide
CID 160952338
2-[3-[[1-[(2-fluorophenyl)methyl]-5-methylpyrazol-3-yl]carbamoyl]pyrazol-1-yl]acetic acid
CID 19501934
2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[(2-fluorophenyl)methyl]acetamide
CID 8695272

Frequently Asked Questions

What is the IUPAC name of 2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide?
The IUPAC name of 2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide (CID 123667405) is 2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide?
The canonical SMILES for 2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide is CN(C)C(=O)Cn1ccc(Nc2cc3[nH]ncc3c(Cc3ccccc3F)n2)n1.
What is the InChIKey of 2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide?
The InChIKey is WJUUXCGEGMYCBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FN7O/c1-27(2)20(29)12-28-8-7-18(26-28)24-19-10-17-14(11-22-25-17)16(23-19)9-13-5-3-4-6-15(13)21/h3-8,10-11H,9,12H2,1-2H3,(H,22,25)(H,23,24,26).
What are the key properties of 2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide?
2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide has a molecular weight of 393.43 g/mol, XLogP of 2.72, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide is sourced from PubChem (CID 123667405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).